Glycoside
GD071636
Name:
NoneFormula:
C18H29O6N4Smiles:
O=C(C(=O)N1CCc2ncc(C[NH+]3CCCC3)n2CC1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1nc2n(c1C[NH+]1CCCC1)CCNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | -3.91 | Num_rotatable_bonds: | 7 |
| MolWt: | 397.45 | Num_heavy_atoms: | 28 |
| TPSA: | 140.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD33650
Formula: C12H21N4
Smiles:
c1nc2n(c1C[NH+]1CCCC1)CCNCC2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.33 | Num_heavy_atoms: | 16 |
| TPSA: | 34.29 | NumAromaticRings: | 1 |
